SCHEMBL7608846

SCHEMBL7608846

CC(CCc1cc2ccccc2cc1P(=O)(O)Cc1ccccc1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
TSHR P16473 1/20 0.38
LTB4R Q15722 3/20 0.38
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.35
CYP1A2 P05177 1/20 0.35
ANPEP P15144 2/20 0.34
ERAP1 Q9NZ08 2/20 0.34
ALDH1A1 P00352 1/20 0.34
ERAP2 Q6P179 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 1/20 0.34
POLB P06746 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7614365 0.80 KMT2A (0.41) CYSLTR2CYSLTR1TSHRLTB4RKMT2A
SCHEMBL7614446 0.79 TBXAS1 (0.40) TSHRLTB4RKMT2AMEN1ANPEP
SCHEMBL8460361 0.77 MEN1 (0.38) KMT2AMEN1CYP1A2
SCHEMBL5134277 0.76 TSHR (0.43) CYSLTR2CYSLTR1TSHRLTB4RKMT2A
SCHEMBL7613680 0.75 ATM (0.38) CYSLTR2CYSLTR1TSHRLTB4RKMT2A
SCHEMBL7610445 0.74 PPARG (0.41) ALDH1A1SMN1; SMN2POLB
SCHEMBL7610507 0.72 AKR1C3 (0.39)
SCHEMBL7607401 0.72 CNR2 (0.40)
SCHEMBL7609846 0.71 CNR2 (0.41)
SCHEMBL1073143 0.70 TSHR (0.68) TSHRLTB4RKMT2AMEN1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020151503-A1 Methods of cancer treatment using naaladase inhibitors SLUSHER BARBARA S (US) 2002-10-17 US claimed
US-6046180-A NAALADase inhibitors GUILFORD PHARMACEUTICALS INC. (US) 2000-04-04 US claimed
US-20020151503-A1 Methods of cancer treatment using naaladase inhibitors SLUSHER BARBARA S (US) 2002-10-17 US disclosed
US-6372726-B1 ADMINISTERING CARBOXYALKYL PHOSPHONATE, PHOSPHORAMIDATE, OR PHOSPHINE OXIDE DERIVATIVE AS ANTITUMOR AGENT TO TREAT CANCER OF PROSTATE GLAND GUILFORD PHARMACEUTICALS INC. 2002-04-16 US disclosed
US-6046180-A NAALADase inhibitors GUILFORD PHARMACEUTICALS INC. (US) 2000-04-04 US disclosed
US-6011021-A GLUTAMATE-DERIVED HYDROXYPHOSPHINYL DERIVATIVE. GUILFORD PHARMACEUTICALS INC. (US) 2000-01-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020151503-A1 Methods of cancer treatment using naaladase inhibitors NAALAD2, DNPEP, ACP3 CYSLTR2 2936/4885CYSLTR1 2360/4885TSHR 4252/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.